子结构搜索

C1CCC2CCCCC2C1

COC(=O)[C@@H]1C[C@@H](Br)C(=O)[C@@H]2[C@@]3(C)C[C@@H](c4ccoc4)OC(=O)[C@H]3CC[C@]21C
Reaction #40600
36
收率 59.0%DOI: 10.6084/m9.figshare.5104873.v1
COC(=O)[C@@H]1C[C@H](N=[N+]=[N-])C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
Reaction #40601
38
收率 87.5%DOI: 10.6084/m9.figshare.5104873.v1
COC(=O)[C@@H]1C[C@H](NC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@H](c3ccoc3)C[C@]21C
Reaction #40603
40
收率 58.0%DOI: 10.6084/m9.figshare.5104873.v1
CCOCO[C@H]1CC[C@@]2(C)[C@H](CC[C@@H]3[C@@H]2CC[C@]2(C)C(O)(CCC(=O)O)CC[C@]32O)C1
Reaction #50277
17-hydroxy-17-(2-carboxyethyl)-3beta-ethoxymethoxy-14-hydroxy-5beta,14beta-androstane
DOI: 10.6084/m9.figshare.5104873.v1
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@]2(C)C(=O)CC[C@@H]12
Reaction #50340
title compound
DOI: 10.6084/m9.figshare.5104873.v1
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)OC(O)C(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C
Reaction #81343
(2S)-2-((1,1-dimethylethoxycarbonyl)-amino)-3-methylbutyric acid [11β,17,21-trihydroxy-3,20-dioxo-pregn-4-en-21-yl] ester
收率 51.0%DOI: 10.6084/m9.figshare.5104873.v1
CC(C)[C@H](N)C(=O)OC(O)C(=O)[C@@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C.O=C(O)C(F)(F)F
Reaction #81344
(2S)-2-amino-3-methyl-butyric acid [11β,17,21-trihydroxy-3,20-dioxo-pregn-4-en-21-yl] ester trifluoroacetate
收率 76.0%DOI: 10.6084/m9.figshare.5104873.v1
CC[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@H]1OC(=O)COC(=O)CNC(=O)OC(C)(C)C
Reaction #93015
above-identified compound
收率 89.2%DOI: 10.6084/m9.figshare.5104873.v1
[Br-]
Reaction #179875
DOI: 10.1039/C8SC04228D
COC(=O)C1CC(Br)C(=O)C2C1(C)CCC1C(=O)OC(c3ccoc3)CC12C
Reaction #180528
DOI: 10.1039/C8SC04228D
CC12CCC(O)C=C1CCC1C2C(=O)CC2(C)C(C(=O)CBr)CCC12
Reaction #192455
DOI: 10.1039/C8SC04228D
CC1OC(=O)C2=CC3CCCCC3C(O)C21
Reaction #192897
DOI: 10.1039/C8SC04228D
[Br-]
Reaction #195530
DOI: 10.1039/C8SC04228D
CCOC(=O)CCOC1CC2(C)C(CCC3C4CCC(C(C)=O)C4(C)CC(=O)C32)CC1O
Reaction #198323
DOI: 10.1039/C8SC04228D
[Br-]
Reaction #199343
DOI: 10.1039/C8SC04228D
CN1CCN(C2CC3(C)C(CCC4C3CCC3(C)C(O)C(N5CCCCC5)CC43)CC2O)CC1
Reaction #207559
DOI: 10.1039/C8SC04228D
COCCC(=O)OCC(=O)C1(O)CCC2C3CC(C)C4=CC(=O)C=CC4(C)C3C(O)CC21C
Reaction #209763
DOI: 10.1039/C8SC04228D
C=C(CC=C(c1ccccc1)c1ccccc1)C1CCC2C3CCC4CC(OC(C)=O)CCC4(C)C3CC(OC(C)=O)C12C
Reaction #221824
DOI: 10.1039/C8SC04228D
CC(CCCC(C)C1CCC2C3CCC4CCCCC4(C)C3CCC12C)COC1OC(COC(=O)C(C)(C)C)C(OCc2ccccc2)C(O)C1OCc1ccccc1
Reaction #223180
DOI: 10.1039/C8SC04228D
CN1CCN(C2CC3C4CCC5CC(O)C(N6CCCCC6)CC5(C)C4CCC3(C)C2O)CC1
Reaction #224722
DOI: 10.1039/C8SC04228D
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